[(2R)-1-[3-(diethylazaniumyl)propyl]-2-(4-ethoxyphenyl)-4,5-bis(oxidanylidene)pyrrolidin-3-ylidene]-(3-methoxyphenyl)methanolate

Systemtic Name: [(2R)-1-[3-(diethylazaniumyl)propyl]-2-(4-ethoxyphenyl)-4,5-bis(oxidanylidene)pyrrolidin-3-ylidene]-(3-methoxyphenyl)methanolate Openeye Name: [(2R)-1-[3-(diethylammonio)propyl]-2-(4-ethoxyphenyl)-4,5-dioxo-pyrrolidin-3-ylidene]-(3-methoxyphenyl)methanolate CAS Name: [(2R)-1-[3-(diethylammonio)propyl]-2-(4-ethoxyphenyl)-4,5-dioxo-3-pyrrolidinylidene]-(3-methoxyphenyl)methanolate IUPAC Name: [(2R)-1-[3-(diethylazaniumyl)propyl]-2-(4-ethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene]-(3-methoxyphenyl)methanolate Traditional Name: [(2R)-1-[3-(diethylammonio)propyl]-4,5-diketo-2-p-phenetyl-pyrrolidin-3-ylidene]-(3-methoxyphenyl)methanolate Formula: C27H34N2O5 MolecularWeight: 466.56926

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN1C(C(=C(C2=CC(=CC=C2)OC)[O-])C(=O)C1=O)C3=CC=C(C=C3)OCC

Isomeric SMILES

CC[NH+](CC)CCCN1[C@@H](C(=C(C2=CC(=CC=C2)OC)[O-])C(=O)C1=O)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C27H34N2O5/c1-5-28(6-2)16-9-17-29-24(19-12-14-21(15-13-19)34-7-3)23(26(31)27(29)32)25(30)20-10-8-11-22(18-20)33-4/h8,10-15,18,24,30H,5-7,9,16-17H2,1-4H3/t24-/m1/s1